1-[2-(4-chlorophenyl)sulfanylpropanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylpropanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxamide CAS Name: 1-[2-[(4-chlorophenyl)thio]-1-oxopropyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-[(4-chlorophenyl)thio]propanoyl]isonipecotamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-16(28-20-9-7-19(23)8-10-20)22(27)25-13-11-18(12-14-25)21(26)24-15-17-5-3-2-4-6-17/h2-10,16,18H,11-15H2,1H3,(H,24,26)